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	hartrees
Energy at 0K	-113.208918
Energy at 298.15K	-113.208779
HF Energy	-113.208918
Nuclear repulsion energy	26.104205

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3919	3559	92.55	103.51	0.30	0.46
2	A'	1499	1361	174.47	3.10	0.33	0.49
3	A'	1288	1169	108.12	4.51	0.63	0.77

Atom	x (Å)	y (Å)
C1	0.059	0.787
O2	0.059	-0.484
H3	-0.825	-0.852

	C1	O2	H3
C1		1.2714	1.8623
O2	1.2714		0.9577
H3	1.8623	0.9577

Number	Element	Mulliken
1	C	-0.041
2	O	-0.148
3	H	0.188

All results from a given calculation for COH (Hydroxymethylidyne)

using model chemistry: HF/cc-pVDZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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	x	y	z	Total
	-1.706	-1.953	0.000	2.593
CHELPG
AIM
ESP

	x	y	z
x	1.720	0.254	0.000
y	0.254	2.152	0.000
z	0.000	0.000	1.416

<r²>	14.344
(<r²>)^1/2	3.787